SCHEMBL2740971

SCHEMBL2740971

O=C(NNc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccccc1Cl)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CRHBP P24387 1/20 0.49
▸ CRHR2 Q13324 1/20 0.49
▸ MAPT P10636 11/20 0.48
▸ KMT2A Q03164 9/20 0.48
▸ ALDH1A1 P00352 8/20 0.48
▸ GAA P10253 7/20 0.48
▸ MEN1 O00255 7/20 0.48
▸ LMNA P02545 6/20 0.48
▸ SMN1; SMN2 Q16637 6/20 0.48
▸ MAPK1 P28482 5/20 0.48
▸ HPGD P15428 4/20 0.48
▸ ALOX12 P18054 3/20 0.48
▸ MCL1 Q07820 3/20 0.48
▸ POLB P06746 3/20 0.48
▸ KDM4E B2RXH2 3/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ THRB P10828 1/20 0.48
▸ HTT P42858 5/20 0.47
▸ NHERF1 O14745 1/20 0.45
▸ PTK2B Q14289 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2740973 0.87 MAPT (0.47) CRHBPCRHR2MAPTKMT2AALDH1A1
SCHEMBL13128930 0.83 SMN1; SMN2 (0.47) MAPTKMT2AALDH1A1GAAMEN1
SCHEMBL2740946 0.79 CRHBP (0.59) CRHBPCRHR2MAPTKMT2AALDH1A1
SCHEMBL2740965 0.78 CRHBP (0.53) CRHBPCRHR2MAPTKMT2AALDH1A1
SCHEMBL2740998 0.78 CRHBP (0.60) CRHBPCRHR2MAPTKMT2AALDH1A1
SCHEMBL2740945 0.77 CRHBP (0.51) CRHBPCRHR2MAPTKMT2AALDH1A1
SCHEMBL2741006 0.76 MEN1 (0.55) CRHBPCRHR2MAPTKMT2AALDH1A1
SCHEMBL2740966 0.76 CRHBP (0.57) CRHBPCRHR2MAPTKMT2AALDH1A1
SCHEMBL2741012 0.75 CRHBP (0.53) CRHBPCRHR2MAPTKMT2AALDH1A1
SCHEMBL2740967 0.75 KMT2A (0.52) CRHBPCRHR2MAPTKMT2AALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088772-B2 Sulfonamides and their use as a medicament THE GENETICS COMPANY, INC. (CH) 2012-01-03 — — US disclosed
US-8088772-B2 Sulfonamides and their use as a medicament THE GENETICS COMPANY, INC. (CH) 2012-01-03 — — US disclosed
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